Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 1/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.39 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | CTSA | P10619 | 1/20 | 0.35 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.35 |
| ▸ | WNT1 | P04628 | 2/20 | 0.35 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.35 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.35 |
| ▸ | HRH2 | P25021 | 1/20 | 0.35 |
| ▸ | HRH1 | P35367 | 1/20 | 0.35 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.34 |
| ▸ | CD38 | P28907 | 1/20 | 0.34 |
| ▸ | SMYD2 | Q9NRG4 | 1/20 | 0.34 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.34 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.34 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.34 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL16973738 | 0.88 | DYRK1A (0.51) | DYRK1ACYP2D6WNT1PRKAA2SMYD3 | |
| SCHEMBL16973650 | 0.84 | GRM5 (0.39) | GRM5CTSAS1PR3PRKAA2CD38 | |
| SCHEMBL16973707 | 0.84 | DYRK1A (0.39) | GRM5DYRK1ACTSAWNT1S1PR3 | |
| SCHEMBL16973824 | 0.79 | GRM5 (0.43) | GRM5CTSACHRM4S1PR3PRKAA2 | |
| SCHEMBL19784084 | 0.76 | CNR1 (0.50) | GRM5SMYD3CD38 | |
| SCHEMBL16973712 | 0.75 | CD38 (0.47) | DYRK1APRKAA2SMYD3CD38 | |
| SCHEMBL16973834 | 0.75 | SMYD3 (0.46) | GRM5SMYD3CD38 | |
| SCHEMBL16973716 | 0.75 | HPGDS (0.51) | DYRK1AWNT1PRKAA2CD38 | |
| SCHEMBL16973678 | 0.75 | DYRK1A (0.51) | DYRK1AWNT1PRKAA2 | |
| SCHEMBL4223897 | 0.75 | DRD2 (0.59) | PRKAA2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2015113927-A1 | AMINO-SUBSTITUTED ISOTHIAZOLES | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2015-08-06 | — | — | WO | disclosed |
| WO-2015113927-A1 | AMINO-SUBSTITUTED ISOTHIAZOLES | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2015-08-06 | — | — | WO | disclosed |